Molecule

ID:74491

General Information
Structure
MolImage
Molecular Formula
C₇H₁₈N₂
Molecular Mass
130.23122
Exact Mass
130.14699859
Charge
0
InChI
InChI=1S/C7H18N2/c8-6-4-2-1-3-5-7-9/h1-9H2
InChIKey
PWSKHLMYTZNYKO-UHFFFAOYSA-N
Canonic Smiles
NCCCCCCCN
Isomeric Smiles
NCCCCCCCN
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-5.5593905
LogD (pH = 7.4)
-4.7198377
Log P
0.48858574
Molar Refractivity
41.1816
Polarizability
16.705751
Polar Surface Area
52.04
Rotatable Bonds
6
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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